5-[(3-methoxyphenyl)methoxy]-2-({4-[2-(trifluoromethoxy)benzoyl]-1,4-diazepan-1-yl}methyl)-4H-pyran-4-one
Chemical Structure Depiction of
5-[(3-methoxyphenyl)methoxy]-2-({4-[2-(trifluoromethoxy)benzoyl]-1,4-diazepan-1-yl}methyl)-4H-pyran-4-one
5-[(3-methoxyphenyl)methoxy]-2-({4-[2-(trifluoromethoxy)benzoyl]-1,4-diazepan-1-yl}methyl)-4H-pyran-4-one
Compound characteristics
| Compound ID: | V006-7625 |
| Compound Name: | 5-[(3-methoxyphenyl)methoxy]-2-({4-[2-(trifluoromethoxy)benzoyl]-1,4-diazepan-1-yl}methyl)-4H-pyran-4-one |
| Molecular Weight: | 532.52 |
| Molecular Formula: | C27 H27 F3 N2 O6 |
| Salt: | not_available |
| Smiles: | COc1cccc(COC2=COC(CN3CCCN(CC3)C(c3ccccc3OC(F)(F)F)=O)=CC2=O)c1 |
| Stereo: | ACHIRAL |
| logP: | 3.946 |
| logD: | 3.9427 |
| logSw: | -4.1437 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 64.237 |
| InChI Key: | ZUKUKLBUILAAOV-UHFFFAOYSA-N |